SCHEMBL4635275

SCHEMBL4635275

O=C(O)Cc1ccc(NC2=NC(=O)C(=Cc3ccc(-c4ccncc4)cc3)S2)cc1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 12/20 0.42
PTPN22 Q9Y2R2 1/20 0.39
FFAR1 O14842 1/20 0.38
DUSP3 P51452 1/20 0.38
DUSP22 Q9NRW4 1/20 0.38
MYC P01106 1/20 0.37
MAX P61244 1/20 0.37
GSK3B P49841 1/20 0.37
KMT2A Q03164 1/20 0.37
NR1H4 Q96RI1 1/20 0.36

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4132445 0.91 FFAR1 (0.47) ALOX5FFAR1DUSP3DUSP22NR1H4
SCHEMBL4132443 0.91 FFAR1 (0.47) ALOX5FFAR1DUSP3DUSP22NR1H4
SCHEMBL4122528 0.90 ALOX5 (0.46) ALOX5PTPN22FFAR1DUSP3DUSP22
SCHEMBL4122531 0.90 ALOX5 (0.46) ALOX5PTPN22FFAR1DUSP3DUSP22
SCHEMBL4634747 0.89 ALOX5 (0.52) ALOX5PTPN22GSK3BKMT2ANR1H4
SCHEMBL4634749 0.89 ALOX5 (0.52) ALOX5PTPN22GSK3BKMT2ANR1H4
SCHEMBL4127925 0.88 ALOX5 (0.53) ALOX5MYCMAXGSK3BNR1H4
SCHEMBL4127928 0.88 ALOX5 (0.53) ALOX5MYCMAXGSK3BNR1H4
SCHEMBL4133988 0.87 PDE4B (0.44) ALOX5PTPN22FFAR1DUSP3DUSP22
SCHEMBL4131357 0.87 ALOX5 (0.40) ALOX5PTPN22FFAR1DUSP3DUSP22

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1934192-A1 THIAZOLINONES AND OXAZOLINONES AND THEIR USE AS PTP1B INHIBITORS Torrent Pharmaceuticals Ltd (IN) 2008-06-25 EP claimed
WO-2007032028-A1 THIAZOLINONES AND OXAZOLINONES AND THEIR USE AS PTP1B INHIBITORS TORRENT PHARMACEUTICALS LTD. (IN) 2007-03-22 WO claimed